Ethyl 17-hydroxyyohimban-16-carboxylate
TL;DR: Ethyl 17-hydroxyyohimban-16-carboxylate (CAS 73840-32-1) is a chemical compound with molecular formula C22H28N2O3 and molecular weight 368.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (1S,15R,18S,19R,20S)-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate
Also Known As: Yohimbic acid, ethyl ester, Yohimbosaeureaethylester, Yohimbic acid ethyl ester, Yohimbosaeureaethylester [German], Ethyl 17-hydroxyyohimban-16-carboxylate
| Molecular Formula | C22H28N2O3 |
|---|---|
| Molecular Weight | 368.21 g/mol |
| LogP | 3.0372 |
| Topological Polar Surface Area | 65.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 368.21 |
| Heavy Atoms | 27 |
| Complexity | 860.36 |
Chemical Identifiers
| CAS Number | 73840-32-1 |
|---|---|
| SMILES | CCOC(=O)[C@H]1[C@H](CC[C@@H]2[C@@H]1C[C@H]3C4=C(CCN3C2)C5=CC=CC=C5N4)O |
Product Overview
Ethyl 17-hydroxyyohimban-16-carboxylate (CAS 73840-32-1), with molecular formula C22H28N2O3 and molecular weight 368.21 g/mol. IUPAC: ethyl (1S,15R,18S,19R,20S)-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate.
Chemical Property Profile of Ethyl 17-hydroxyyohimban-16-carboxylate
Property Insights of Ethyl 17-hydroxyyohimban-16-carboxylate
The XLogP value of 3.0372 indicates that Ethyl 17-hydroxyyohimban-16-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.56 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 17-hydroxyyohimban-16-carboxylate. Following Lipinski's Rule of Five, Ethyl 17-hydroxyyohimban-16-carboxylate has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 17-hydroxyyohimban-16-carboxylate?
The CAS number of Ethyl 17-hydroxyyohimban-16-carboxylate is 73840-32-1.
What is the molecular formula of Ethyl 17-hydroxyyohimban-16-carboxylate?
The molecular formula of Ethyl 17-hydroxyyohimban-16-carboxylate is C22H28N2O3.
What is the molecular weight of Ethyl 17-hydroxyyohimban-16-carboxylate?
The molecular weight of Ethyl 17-hydroxyyohimban-16-carboxylate is 368.21 g/mol.
Where can I buy Ethyl 17-hydroxyyohimban-16-carboxylate?
You can request a quote for Ethyl 17-hydroxyyohimban-16-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 17-hydroxyyohimban-16-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 17-hydroxyyohimban-16-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.